⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4580220 | 0.77 | — | — | |
| SCHEMBL28132544 | 0.72 | — | — | |
| SCHEMBL1616675 | 0.72 | — | — | |
| SCHEMBL598504 | 0.69 | — | — | |
| SCHEMBL28486948 | 0.67 | — | — | |
| SCHEMBL15418558 | 0.65 | MAPK1 (0.32) | — | |
| SCHEMBL2399066 | 0.65 | MAPK1 (0.32) | — | |
| SCHEMBL13602659 | 0.65 | CYP2D6 (0.32) | — | |
| SCHEMBL20610172 | 0.65 | TSHR (0.33) | — | |
| SCHEMBL26275380 | 0.65 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2162430-B1 | MERCAPTAN MIXTURE | ARLANXEO DEUTSCHLAND GMBH (DE) | 2016-11-30 | — | — | EP | claimed |
| EP-2238176-B1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2014-08-20 | — | — | EP | claimed |
| US-8623981-B2 | Nitrile rubbers which optionally contain alkylthio terminal groups and which are optionally hydrogenated | LANXESS DEUTSCHLAND GMBH (DE) | 2014-01-07 | — | — | US | claimed |
| EP-2238177-B1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2012-07-25 | — | — | EP | claimed |
| EP-2238175-B1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2011-12-14 | — | — | EP | claimed |
| US-20110123747-A1 | Nitrile rubbers which optionally contain alkylthio terminal groups and which are optionally hydrogenated | LANXESS DEUTSCHLAND GMBH (DE) | 2011-05-26 | — | — | US | claimed |
| US-20110123748-A1 | Nitrile rubbers which optionally contain alkylthio terminal groups and which are optionally hydrogenated | LANXESS DEUTSCHLAND GMBH (DE) | 2011-05-26 | — | — | US | claimed |
| EP-2152760-B1 | NITRILE RUBBERS | LANXESS DEUTSCHLAND GMBH (DE) | 2011-05-04 | — | — | EP | claimed |
| US-7923518-B2 | Nitrile rubbers | LANXESS DEUTSCHLAND GMBH (DE) | 2011-04-12 | — | — | US | claimed |
| JP-2011511111-A | — | — | 2011-04-07 | — | — | JP | claimed |
| US-20110059279-A1 | Nitrile rubbers which optionally contain alkylthio terminal groups and which are optionally hydrogenated | LANXESS DEUTSCHLAND GMBH (DE) | 2011-03-10 | — | — | US | claimed |
| EP-2238177-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS Deutschland GmbH (DE) | 2010-10-13 | — | — | EP | claimed |
| EP-2238176-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS Deutschland GmbH (DE) | 2010-10-13 | — | — | EP | claimed |
| EP-2238175-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS Deutschland GmbH (DE) | 2010-10-13 | — | — | EP | claimed |
| EP-2152760-A1 | NITRILE RUBBERS | Lanxess Deutschland GmbH (DE) | 2010-02-17 | — | — | EP | claimed |
| WO-2009095317-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2009-08-06 | — | — | WO | claimed |
| WO-2009095313-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2009-08-06 | — | — | WO | claimed |
| WO-2009095315-A1 | NITRILE RUBBERS WHICH OPTIONALLY CONTAIN ALKYLTHIO TERMINAL GROUPS AND WHICH ARE OPTIONALLY HYDROGENATED | LANXESS DEUTSCHLAND GMBH (DE) | 2009-08-06 | — | — | WO | claimed |
| WO-2008142035-A1 | NITRILE RUBBERS | LANXESS DEUTSCHLAND GMBH (DE) | 2008-11-27 | — | — | WO | claimed |
| US-20080293889-A1 | NITRILE RUBBERS | LANXESS DEUTSCHLAND GMBH (DE) | 2008-11-27 | — | — | US | claimed |